2-[(3R,4S)-3-ethyl-1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[(3R,4S)-3-ethyl-1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[(3R,4S)-3-ethyl-1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]-1-morpholino-ethanone CAS Name: 2-[(3R,4S)-3-ethyl-1-(1H-indol-3-ylmethyl)-4-piperidin-1-iumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[(3R,4S)-3-ethyl-1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[(3R,4S)-3-ethyl-1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-yl]-1-morpholino-ethanone Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C[NH+](CCC1CC(=O)N2CCOCC2)CC3=CNC4=CC=CC=C43

Isomeric SMILES

CC[C@H]1C[NH+](CC[C@H]1CC(=O)N2CCOCC2)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H31N3O2/c1-2-17-15-24(16-19-14-23-21-6-4-3-5-20(19)21)8-7-18(17)13-22(26)25-9-11-27-12-10-25/h3-6,14,17-18,23H,2,7-13,15-16H2,1H3/p+1/t17-,18-/m0/s1